methyl 4-[[4,5-dimethoxy-2-[methylsulfonyl-(phenylmethyl)amino]phenyl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[4,5-dimethoxy-2-[methylsulfonyl-(phenylmethyl)amino]phenyl]carbonylamino]benzoate Openeye Name: methyl 4-[[2-[benzyl(methylsulfonyl)amino]-4,5-dimethoxy-benzoyl]amino]benzoate CAS Name: 4-[[[4,5-dimethoxy-2-[methylsulfonyl-(phenylmethyl)amino]phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[benzyl(methylsulfonyl)amino]-4,5-dimethoxybenzoyl]amino]benzoate Traditional Name: 4-[[2-[benzyl(mesyl)amino]-4,5-dimethoxy-benzoyl]amino]benzoic acid methyl ester Formula: C25H26N2O7S MolecularWeight: 498.54814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NC2=CC=C(C=C2)C(=O)OC)N(CC3=CC=CC=C3)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NC2=CC=C(C=C2)C(=O)OC)N(CC3=CC=CC=C3)S(=O)(=O)C)OC

InChI

InChI=1S/C25H26N2O7S/c1-32-22-14-20(24(28)26-19-12-10-18(11-13-19)25(29)34-3)21(15-23(22)33-2)27(35(4,30)31)16-17-8-6-5-7-9-17/h5-15H,16H2,1-4H3,(H,26,28)